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(5R)-4-acetyl-1-(4-chloro-2-fluorophenyl)-5-cyclohexyl-3-hydroxy-5H-pyrrol-2-one

(5R)-4-acetyl-1-(4-chloro-2-fluorophenyl)-5-cyclohexyl-3-hydroxy-5H-pyrrol-2-one

CAS: 512177-83-2

Formula: C18H19ClFNO3

SMILES: CC(=O)C1=C(O)C(=O)N([C@@H]1C1CCCCC1)C1=C(F)C=C(Cl)C=C1

IUPAC: (5R)-4-acetyl-1-(4-chloro-2-fluorophenyl)-5-cyclohexyl-3-hydroxy-2,5-dihydro-1H-pyrrol-2-one

InChI: InChI=1S/C18H19ClFNO3/c1-10(22)15-16(11-5-3-2-4-6-11)21(18(24)17(15)23)14-8-7-12(19)9-13(14)20/h7-9,11,16,23H,2-6H2,1H3/t16-/m1/s1

Composition: C (61.45%), H (5.44%), Cl (10.08%), F (5.40%), N (3.98%), O (13.64%)

Molar Mass: 351.8

Atom Count: 43

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 351.1037493
Formal Charge 0
FSP3 0.44
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey VQNLJXWZGVRLBA-MRXNPFEDSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.83
Topological Polar Surface Area 57.61
Polarizability 34.23
Ring Count 3
Rotatable Bond Count 3

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